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4,5-DINITRO-2-(TRIFLUOROMETHYL)-IMIDAZOLE
SpectraBase Compound ID 81A7GAbvGMt
InChI InChI=1S/C4HF3N4O4/c5-4(6,7)3-8-1(10(12)13)2(9-3)11(14)15/h(H,8,9)
InChIKey RQZKQQNNVFRKFT-UHFFFAOYSA-N
Mol Weight 226.07 g/mol
Molecular Formula C4HF3N4O4
Exact Mass 225.994989 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MHaB8uDByo
Name 4,5-Dinitro-2-(trifluoromethyl)-1H-imidazole
CAS Registry Number 104752-70-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4HF3N4O4
InChI InChI=1S/C4HF3N4O4/c5-4(6,7)3-8-1(10(12)13)2(9-3)11(14)15/h(H,8,9)
InChIKey RQZKQQNNVFRKFT-UHFFFAOYSA-N
Molecular Weight 226.071 g/mol
SMILES [nH]1c(c(nc1C(F)(F)F)N(=O)=O)N(=O)=O
SPLASH splash10-0002-9100000000-b2499aa90799221925a8
Source of Spectrum NP-5-6366-0
Synonyms Imidazole, 2-trifluoromethyl-4,5-dinitro-
Wiley ID 1105020